N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide

C23H26N4O4 — CID 45356013

IUPACN-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide
SMILESCCCc1ccc(C2(C)NC(=O)N(CC(=O)Nc3ccc(NC(C)=O)cc3)C2=O)cc1
InChIInChI=1S/C23H26N4O4/c1-4-5-16-6-8-17(9-7-16)23(3)21(30)27(22(31)26-23)14-20(29)25-19-12-10-18(11-13-19)24-15(2)28/h6-13H,4-5,14H2,1-3H3,(H,24,28)(H,25,29)(H,26,31)
InChIKeyYLZWHPJGPIGZFU-UHFFFAOYSA-N
MW422.49 g/mol
LogP3.00
Rot. Bonds7

About N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide

N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide (PubChem CID 45356013) has the molecular formula C23H26N4O4 and a molecular weight of 422.49 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide
PubChem CID45356013
Molecular FormulaC23H26N4O4
Molecular Weight422.49 g/mol
Exact Mass422.20
IUPAC NameN-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide
SMILESCCCc1ccc(C2(C)NC(=O)N(CC(=O)Nc3ccc(NC(C)=O)cc3)C2=O)cc1
InChIInChI=1S/C23H26N4O4/c1-4-5-16-6-8-17(9-7-16)23(3)21(30)27(22(31)26-23)14-20(29)25-19-12-10-18(11-13-19)24-15(2)28/h6-13H,4-5,14H2,1-3H3,(H,24,28)(H,25,29)(H,26,31)
InChIKeyYLZWHPJGPIGZFU-UHFFFAOYSA-N
XLogP3.00
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.49
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide (CID 45356013) is N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide is CCCc1ccc(C2(C)NC(=O)N(CC(=O)Nc3ccc(NC(C)=O)cc3)C2=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide?
The InChIKey is YLZWHPJGPIGZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O4/c1-4-5-16-6-8-17(9-7-16)23(3)21(30)27(22(31)26-23)14-20(29)25-19-12-10-18(11-13-19)24-15(2)28/h6-13H,4-5,14H2,1-3H3,(H,24,28)(H,25,29)(H,26,31).
What are the key properties of N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide?
N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide has a molecular weight of 422.49 g/mol, XLogP of 3.00, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-[4-methyl-2,5-dioxo-4-(4-propylphenyl)imidazolidin-1-yl]acetamide is sourced from PubChem (CID 45356013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).